# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/cec19225-b9df-4bde-85a2-7dca6945d83b/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for GeS / Pnma (62) / materials id 2242](https://mdr.nims.go.jp/datasets/e2ac239a-a25d-4e2e-a16d-2d45b60e2f02) ## Fulltext elements: [S, Ge]cutoff: 8.0pair_type: gaussianfeature_type: gtinvmodel_type: 3max_p: 2max_l: 8gtinv_order: 3gtinv_maxl: [8, 8]gtinv_sym: [0, 0]gtinv_version: 1electrostatic: 0mass: [32.07, 72.61]n_pair_params: 11pair_params:- [1.0, 0.0]- [1.0, 0.7777777777777778]- [1.0, 1.5555555555555556]- [1.0, 2.3333333333333335]- [1.0, 3.111111111111111]- [1.0, 3.888888888888889]- [1.0, 4.666666666666667]- [1.0, 5.444444444444445]- [1.0, 6.222222222222222]- [1.0, 7.0]- [0.0, 0.0]n_type_pairs: 3type_pairs:- atom_type_pair: [0, 0] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [0, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [1, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]type_full: 1type_indices: [0, 1]n_coeffs: 8283coeffs: [-1.140098844749637e+03, 5.978498414175332e+00, 2.296878620921410e+01, 0.000000000000000e+00, -1.431604155297338e+06, -1.100455095917222e+03, -3.554188618556101e+05, -2.423285425678112e+07, 0.000000000000000e+00, -3.960982937276736e+06, 1.288288273708382e+04, -8.643073507541358e+04, 2.550778116511919e+07, 0.000000000000000e+00, 1.429157360900612e+05, 1.145420895915814e+04, -3.333407635762216e+05, -3.420924449059129e+07, 0.000000000000000e+00, 5.198908535163063e+06, -5.703473937888101e+02, -3.121462820084593e+06, 1.843269121590166e+07, 0.000000000000000e+00, 4.697063094550244e+06, -4.847192302135800e+02, 1.896516346936131e+06, -1.645727831454725e+07, 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